tert-butyl 4-[4-[(E)-5-ethoxy-5-oxidanylidene-pent-1-enyl]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(E)-5-ethoxy-5-oxidanylidene-pent-1-enyl]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(E)-5-ethoxy-5-oxo-pent-1-enyl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(E)-5-ethoxy-5-oxopent-1-enyl]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(E)-5-ethoxy-5-oxopent-1-enyl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(E)-5-ethoxy-5-keto-pent-1-enyl]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC=CC1=CC=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC/C=C/C1=CC=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H32N2O4/c1-5-27-20(25)9-7-6-8-18-10-12-19(13-11-18)23-14-16-24(17-15-23)21(26)28-22(2,3)4/h6,8,10-13H,5,7,9,14-17H2,1-4H3/b8-6+